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3-(1,3-benzodioxol-5-yl)-2-benzoylprop-2-enenitrile

3-(1,3-benzodioxol-5-yl)-2-benzoylprop-2-enenitrile structure

CAS No:
331458-29-8
Formula:
C17H11NO3
Chemical Name:
3-(1,3-benzodioxol-5-yl)-2-benzoylprop-2-enenitrile
Synonyms:
SCHEMBL12732154;AKOS034344067;MCULE-8200486469;NCI60_014635;Z44305311;2-benzoyl-3-(2H-1,3-benzodioxol-5-yl)prop-2-enenitrile;331458-29-8

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3-(1,3-benzodioxol-5-yl)-2-benzoylprop-2-enenitrile Basic Attributes

Molecular Weight：

277.27 g/mol

Exact Mass：

277.07389321 g/mol

Characteristics

PSA：

59.3 Å²

Computed Properties

Molecular Weight:277.27
XLogP3:3.4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:277.07389321
Monoisotopic Mass:277.07389321
Topological Polar Surface Area:59.3
Heavy Atom Count:21
Complexity:470
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(1,3-benzodioxol-5-yl)-2-benzoylprop-2-enenitrile

Basic Attributes
Characteristics
Computed Properties

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